Monomers
Ethyl 2-chloroacrylate
Identifiers
IUPAC name
ethyl 2-chloroprop-2-enoate
InchI
InChI=1S/C5H7ClO2/c1-3-8-5(7)4(2)6/h2-3H2,1H3
InchI Key
CVUNPKSKGHPMSY-UHFFFAOYSA-N
SMILES
CCOC(=O)C(=C)Cl
Canonical SMILES
CCOC(=O)C(=C)Cl
Isomeric SMILES
CCOC(=O)C(=C)Cl
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C5H7ClO2
Heavy Atom Count
8
Molecular Weight
134.562
Exact Molecular Weight
134.0135
Valence Electrons
46
Radical Electrons
0
tPSA
26.3
MolLogP
1.302
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
15 14 0 0 0 0 0 0 0 0999 V2000
-2.1360 0.6104 -0.1979 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5127 -0.5443 0.5677 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1212 -0.3461 0.7186 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6415 -0.2390 -0.4394 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0360 -0.3266 -1.5532 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0619 -0.0369 -0.4509 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7288 0.0594 0.6642 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8954 0.0798 -1.9596 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-2.1645 0.4158 -1.2888 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2117 0.6871 0.1211 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6132 1.5769 0.0134 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6742 -1.4497 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0187 -0.6968 1.5416 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8149 0.2140 0.6823 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2737 -0.0041 1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 1 0
4 5 2 0
4 6 1 0
6 7 2 3
6 8 1 0
1 9 1 0
1 10 1 0
1 11 1 0
2 12 1 0
2 13 1 0
7 14 1 0
7 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers